5-chloranyl-3-methyl-2-oxidanyl-6-propan-2-yl-benzoate

Systemtic Name: 5-chloranyl-3-methyl-2-oxidanyl-6-propan-2-yl-benzoate Openeye Name: 5-chloro-2-hydroxy-6-isopropyl-3-methyl-benzoate CAS Name: 5-chloro-2-hydroxy-3-methyl-6-propan-2-ylbenzoate IUPAC Name: 5-chloro-2-hydroxy-3-methyl-6-propan-2-ylbenzoate Traditional Name: 5-chloro-2-hydroxy-6-isopropyl-3-methyl-benzoate Formula: C11H12ClO3- MolecularWeight: 227.66418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C(=O)[O-])C(C)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1O)C(=O)[O-])C(C)C)Cl

InChI

InChI=1S/C11H13ClO3/c1-5(2)8-7(12)4-6(3)10(13)9(8)11(14)15/h4-5,13H,1-3H3,(H,14,15)/p-1